{ "property-id" "tag:staff@noreply.openkim.org,2014-04-15:property/cohesive-energy-relation-cubic-crystal" "instance-id" 1 "short-name" { "source-value" [ "diamond" ] } "species" { "source-value" [ "B" "B" "B" "B" "B" "B" "B" "B" ] } "a" { "source-value" [ 5.67056 5.290611 5.055134 4.884047 4.749593 4.638819 4.544619 4.462673 4.390156 4.325122 4.266168 4.212256 4.162589 ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ 5.670560000000001e-10 5.290611000000001e-10 5.055134e-10 4.884047e-10 4.749593e-10 4.638819e-10 4.544619e-10 4.462673e-10 4.390156e-10 4.325122000000001e-10 4.266168e-10 4.212256e-10 4.162589e-10 ] } "basis-atom-coordinates" { "source-value" [ [ 0 0 0 ] [ 0 0.5 0.5 ] [ 0.5 0.5 0 ] [ 0.5 0 0.5 ] [ 0.75 0.25 0.75 ] [ 0.25 0.25 0.25 ] [ 0.25 0.75 0.75 ] [ 0.75 0.75 0.25 ] ] } "cohesive-potential-energy" { "source-value" [ 1.48447 2.22514 2.8761 3.47272 4.03039 4.55279 5.0456 5.50884 5.94399 6.3519 6.73348 7.08948 7.41894 ] "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" [ 2.378383128278976e-19 3.565067286006912e-19 4.608020179082881e-19 5.563910794584576e-19 6.457396630706112e-19 7.294373697412032e-19 8.083942357908481e-19 8.826134655727874e-19 9.523321812268992e-19 1.017686567765952e-18 1.078822423262438e-18 1.135859910962919e-18 1.188645221911795e-18 ] } }